| SpectraBase Compound ID | 7WNDjC291wy |
|---|---|
| InChI | InChI=1S/C15H24O2/c1-9-5-6-11(15(3,4)17)7-13-10(2)14(16)8-12(9)13/h8-11,13,17H,5-7H2,1-4H3/t9-,10+,11+,13-/m0/s1 |
| InChIKey | OXURLMMPMKOJKK-WGBDABJCSA-N |
| Mol Weight | 236.35 g/mol |
| Molecular Formula | C15H24O2 |
| Exact Mass | 236.17763 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DtaECZqcOWI |
|---|---|
| Name | 1-Guaiene-11-ol-3-one |
| Alternate Name(s) | 3,8-Dimethyl-5-(.alpha.-hydroxyisopropyl)-2-oxo-perhydro-.delta.-1(8a)-azulene (1R,4S,7R,8aS)-7-(2-hydroxypropan-2-yl)-1,4-dimethyl-4,5,6,7,8,8a-hexahydro-1H-azulen-2-one (1R,4S,7R,8aS)-1,4-dimethyl-7-(2-oxidanylpropan-2-yl)-4,5,6,7,8,8a-hexahydro-1H-azulen-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H24O2 |
| InChI | InChI=1S/C15H24O2/c1-9-5-6-11(15(3,4)17)7-13-10(2)14(16)8-12(9)13/h8-11,13,17H,5-7H2,1-4H3/t9-,10+,11+,13-/m0/s1 |
| InChIKey | OXURLMMPMKOJKK-WGBDABJCSA-N |
| Molecular Weight | 236.355 g/mol |
| SMILES | OC([C@]1(C[C@@]2(C(=CC(=O)[C@@]2(C)[H])[C@](CC1)(C)[H])[H])[H])(C)C |
| SPLASH | splash10-0gvk-0970000000-ec60ff1fe7bf6cada7ad |
| Source of Spectrum | G4-70-852-6 |
| Wiley ID | 1694696 |